N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromanyl-butanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromanyl-butanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromo-butanamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromobutanamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromobutanamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-bromo-butyramide Formula: C13H14BrN3O2S MolecularWeight: 356.23816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C)Br

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C)Br

InChI

InChI=1S/C13H14BrN3O2S/c1-3-9(14)12(19)17-13-16-10-5-4-8(15-7(2)18)6-11(10)20-13/h4-6,9H,3H2,1-2H3,(H,15,18)(H,16,17,19)